Information card for entry 7217032

Structure parameters

• Common name: sulfacetamide4-aminopyridineSalt
• Chemical name: N-4-aminophenylsulfonylacetamidePyridine-4-amine
• Formula: C13 H16 N4 O3 S
• Calculated formula: C13 H16 N4 O3 S
• SMILES: S(=O)([O-])(c1ccc(cc1)N)=NC(=O)C.[nH+]1ccc(cc1)N
• Title of publication: Modulating the solubility of sulfacetamide by means of cocrystals
• Authors of publication: Rajesh Goud, N.; Khan, Ronaq Ali; Nangia, Ashwini
• Journal of publication: CrystEngComm
• Year of publication: 2014
• Journal volume: 16
• Journal issue: 26
• Pages of publication: 5859
• a: 7.7413 ± 0.0007 Å
• b: 17.8726 ± 0.0016 Å
• c: 11.0065 ± 0.001 Å
• α: 90°
• β: 97.879 ± 0.001°
• γ: 90°
• Cell volume: 1508.5 ± 0.2 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0552
• Residual factor for significantly intense reflections: 0.0496
• Weighted residual factors for significantly intense reflections: 0.1195
• Weighted residual factors for all reflections included in the refinement: 0.1226
• Goodness-of-fit parameter for all reflections included in the refinement: 1.191
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No